Search Result "molecular docking"


Studies of Benzothiadiazine Derivatives as Hepatitis C Virus NS5B Polymerase Inhibitors Using 3D-QSAR, Molecular Docking and Molecular Dynamics

Journal: Current Medicinal Chemistry
Volume: 17 Issue: 2 Year: 2010 Page: 2788-2803
Author(s): X. Wang, W. Yang, X. Xu, H. Zhang, Y. Li, Y. Wang

Acetylcholinesterase Reprised: Molecular Modeling with the Whole Toolkit

Ebook: Young People’s Visions of the World

Volume: 5 Year: 2010
Author(s): Gerald H. Lushington, Jian-Xin Guo, Margaret M. Hurley
Doi: 10.2174/97816080520801100501

Molecular Lipophilicity in Protein Modeling and Drug Design

Ebook: Young People’s Visions of the World

Volume: 6 Year: 2010
Author(s): Roman G. Efremov,Anton O. Chugunov,Timothy V. Pyrkov,John P. Priestle,Vladimir M. Pentkovsky,Alexander S. Arseniev,Edgar Jacoby
Doi: 10.2174/97816080546401130601

Design and Development of Molecular Imaging Probes

Journal: Current Topics in Medicinal Chemistry
Volume: 10 Issue: 1 Year: 2010 Page: 1227-1236
Author(s): Kai Chen, Xiaoyuan Chen

Three Dimensional Molecular Field Analysis of Thiomorpholine Analogs of TACE Inhibitors Using Receptor Based Alignment

Journal: Letters in Drug Design & Discovery
Volume: 7 Issue: 4 Year: 2010 Page: 269-274
Author(s): Malkeet Singh Bahia, Neha Bagga, Rambabu Gundla, Om Silakari

Development of a Web Service for the Investigation of Complexation by Cyclodextrins

Journal: Letters in Drug Design & Discovery
Volume: 7 Issue: 3 Year: 2010 Page: 200-207
Author(s): Zsolt Bikadi, Istvan Hazai, Laszlo Demko, Peter Hari, Eszter Hazai

MolDock Applied to Structure-Based Virtual Screening

Journal: Current Drug Targets
Volume: 11 Issue: 3 Year: 2010 Page: 327-334
Author(s): Walter Filgueira De Azevedo Jr.

Post Processing of Protein-Compound Docking for Fragment-Based Drug Discovery (FBDD): In-Silico Structure-Based Drug Screening and Ligand-Binding Pose Prediction

Journal: Current Topics in Medicinal Chemistry
Volume: 10 Issue: 6 Year: 2010 Page: 680-694
Author(s): Yoshifumi Fukunishi

Natural Products in Structure-Assisted Design of Molecular Cancer Therapeutics

Journal: Current Pharmaceutical Design
Volume: 16 Issue: 1 Year: 2010 Page: 1718-1741
Author(s): Petra H. Pfisterer, Gerhard Wolber, Thomas Efferth, Judith M. Rollinger, Hermann Stuppner

Molecular Recognition and Drug-Lead Identification: What Can Molecular Simulations Tell Us?

Journal: Current Medicinal Chemistry
Volume: 17 Issue: 1 Year: 2010 Page: 25-41
Author(s): G. Morra, A. Genoni, M. A.C. Neves, K. M. Merz Jr., G. Colombo

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